3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-(5-chloropyridin-2-yl)propanamide
Chemical Structure Depiction of
3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-(5-chloropyridin-2-yl)propanamide
3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-(5-chloropyridin-2-yl)propanamide
Compound characteristics
| Compound ID: | G395-1479 |
| Compound Name: | 3-(6-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}[1,2,4]triazolo[4,3-b]pyridazin-3-yl)-N-(5-chloropyridin-2-yl)propanamide |
| Molecular Weight: | 451.87 |
| Molecular Formula: | C21 H18 Cl N7 O3 |
| Smiles: | C(Cc1nnc2ccc(NCc3ccc4c(c3)OCO4)nn12)C(Nc1ccc(cn1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6481 |
| logD: | 2.6317 |
| logSw: | -3.4904 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.144 |
| InChI Key: | WZQUDWIZAPAFSF-UHFFFAOYSA-N |